hexyl 2-oxidanylidenecyclohexane-1-carboxylate

Systemtic Name: hexyl 2-oxidanylidenecyclohexane-1-carboxylate Openeye Name: hexyl 2-oxocyclohexanecarboxylate CAS Name: 2-oxo-1-cyclohexanecarboxylic acid hexyl ester IUPAC Name: hexyl 2-oxocyclohexane-1-carboxylate Traditional Name: 2-ketocyclohexanecarboxylic acid hexyl ester Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1CCCCC1=O

Isomeric SMILES

CCCCCCOC(=O)C1CCCCC1=O

InChI

InChI=1S/C13H22O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h11H,2-10H2,1H3